Crystallography Open Database

Information card for entry 7154967

Preview

Coordinates	7154967.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H48 F12 N4 O6 P2
Calculated formula	C34 H48 F12 N4 O6 P2
Title of publication	Reversible morphological changes of assembled supramolecular amphiphiles triggered by pH-modulated host-guest interactions.
Authors of publication	Olson, M. A.; Messina, M. S.; Thompson, J. R.; Dawson, T. J.; Goldner, A. N.; Gaspar, D. K.; Vazquez, M.; Lehrman, J. A.; Sue, A. C.-H.
Journal of publication	Organic & biomolecular chemistry
Year of publication	2016
Journal volume	14
Journal issue	24
Pages of publication	5714 - 5720
a	8.1218 ± 0.0009 Å
b	11.2172 ± 0.0012 Å
c	11.2671 ± 0.0012 Å
α	79.387 ± 0.001°
β	79.478 ± 0.001°
γ	84.213 ± 0.001°
Cell volume	989.55 ± 0.19 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0618
Residual factor for significantly intense reflections	0.0547
Weighted residual factors for significantly intense reflections	0.1418
Weighted residual factors for all reflections included in the refinement	0.1489
Goodness-of-fit parameter for all reflections included in the refinement	1.028
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
183764 (current)	2016-06-18	cif/ Updating files of 7154967 Original log message: Adding full bibliography for 7154967.cif.	7154967.cif
176287	2016-02-09	cif/ Adding structures of 7154967 via cif-deposit CGI script.	7154967.cif